AI09937
1158750-70-9 | 1-Benzyl-4-(4-methoxyphenyl)piperidine-4-carbonitrile
Manufacturer: A2B Chem
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CatalogNumber
AI09937
ChemicalName
1-Benzyl-4-(4-methoxyphenyl)piperidine-4-carbonitrile
CasNumber
1158750-70-9
MolecularFormula
C20H22N2O
MolecularWeight
306.4015
MdlNumber
MFCD12406448
Smiles
COc1ccc(cc1)C1(CCN(CC1)Cc1ccccc1)C#N
Complexity
405
Covalently-bondedUnitCount
1
HeavyAtomCount
23
HydrogenBondAcceptorCount
3
RotatableBondCount
4
Xlogp3
3.4
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CatalogNumber: AI09937
ChemicalName: 1-Benzyl-4-(4-methoxyphenyl)piperidine-4-carbonitrile
CasNumber: 1158750-70-9
MolecularFormula: C20H22N2O
MolecularWeight: 306.4015
MdlNumber: MFCD12406448
Smiles: COc1ccc(cc1)C1(CCN(CC1)Cc1ccccc1)C#N
Complexity: 405
Covalently-bondedUnitCount: 1
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 3
RotatableBondCount: 4
Xlogp3: 3.4
CatalogNumber:
AI09937
ChemicalName:
1-Benzyl-4-(4-methoxyphenyl)piperidine-4-carbonitrile
CasNumber:
1158750-70-9
MolecularFormula:
C20H22N2O
MolecularWeight:
306.4015
MdlNumber:
MFCD12406448
Smiles:
COc1ccc(cc1)C1(CCN(CC1)Cc1ccccc1)C#N
Complexity:
405
Covalently-bondedUnitCount:
1
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
3
RotatableBondCount:
4
Xlogp3:
3.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C1CCC(CC1)CCNC(=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1CCC(CC1)CCNC(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AI09939
ChemicalName: 2-(2-(tert-Butoxycarbonyl)-1,2,3,4-tetrahydroisoquinolin-7-yl)acetic acid
CasNumber: 1158755-34-0
MolecularFormula: C16H21NO4
MolecularWeight: 291.34223999999995
MdlNumber: MFCD12406199
Smiles: O=C(N1CCc2c(C1)cc(cc2)CC(=O)O)OC(C)(C)C
Complexity: 402
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 4
RotatableBondCount: 4
Xlogp3: 2.1
CatalogNumber:
AI09939
ChemicalName:
2-(2-(tert-Butoxycarbonyl)-1,2,3,4-tetrahydroisoquinolin-7-yl)acetic acid
CasNumber:
1158755-34-0
MolecularFormula:
C16H21NO4
MolecularWeight:
291.34223999999995
MdlNumber:
MFCD12406199
Smiles:
O=C(N1CCc2c(C1)cc(cc2)CC(=O)O)OC(C)(C)C
Complexity:
402
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
4
RotatableBondCount:
4
Xlogp3:
2.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(NC1(C)CNC1)OCc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(NC1(C)CNC1)OCc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__